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Concept information

Preferred term

هرونامید B  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • 0

formula

  • C29H39NO3

inchi

  • InChI=1S/C29H39NO3/c1-4-5-6-7-8-9-12-24-19-22-15-14-20(2)18-23-16-17-26(31)28(32)27(23)21(3)11-10-13-25(22)29(33)30-24/h6-11,13-18,22-28,31-32H,4-5,12,19H2,1-3H3,(H,30,33)/b7-6+,9-8+,13-10+,15-14+,20-18+,21-11+/t22-,23-,24+,25+,26-,27-,28-/m0/s1

inchikey

  • SBSRDDBYEIPHHD-DBJJYDABSA-N

mass

  • 449.635

monoisotopicmass

  • 449.29299

smiles

  • O=C1N[C@@H](C[C@H]2[C@H]1C=CC=C([C@H]3[C@@H](C=C[C@@H]([C@@H]3O)O)C=C(C=C2)C)C)C/C=C/C=C/CCC

subset

  • 2_STAR

synonym EXACT

  • (1R,2E,4E,6R,9R,11R,12E,14E,16S,19S,20R)-19,20-dihydroxy-2,14-dimethyl-9-[(2E,4E)-octa-2,4-dienyl]-8-azatricyclo[14.4.0.06,11]icosa-2,4,12,14,17-pentaen-7-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:220050

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